Geometry & MOs

Info

ID:	408066
PubChem CID:	135080821
Reduced:	N2O2C7H12 (1)
Stoich.:	A2B2C7D12 (1)
Weight, g/mol:	222.116841
ΔH_f, kcal/mol:	-47.21
Dipole, Da:	1.25
IP(EA), eV:	-9.12(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[(4-fluorophenyl)methyl]aziridin-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1(OCC(O1)CC=[N+]=[N-])C

DOS

IR

Vibrations